0  B27R3.605750925  CC(CC1=CC=CC=C1)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-1230178094 [0,0,0,0,0,0|0,0,0]=0
1  B27R3.605750925  CC(CC1=CC=CC=C1)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-6250721839 [0,0,0,0,0,0|0,0,0]=0
2  B28R3.2044155479  CC(NCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C(O)C3=CC=CC=C3 MCULE-8072042599 [0,1,0,0,0,0|0,0,0]=1
3  B28R3.2044155479  C[C@H](NCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)[C@H](O)C3=CC=CC=C3 MCULE-4320038429 [0,1,0,0,0,0|0,0,0]=1
4  B28R3.2044155479  C[C@H](NCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)[C@H](O)C3=CC=CC=C3 MCULE-4533319731 [0,1,0,0,0,0|0,0,0]=1
5  B28R4.190470352  CN1C(=O)C2=C(N=CN2CCN3C(=O)NC4=C3C=CC=C4)N(C1=O)C MCULE-4172788296 [0,0,0,1,0,0|2,0,1]=4
6  B26R3.535608627  CN1C(=O)C2=C(N=CN2CCC(=O)NC3=CC=CC=C3)N(C1=O)C MCULE-9570795967 [0,0,0,0,1,0|2,0,1]=4
7  B27R3.605750903  CN1C(=O)C2=C(N=CN2CC(=O)NCCC3=CC=CC=C3)N(C1=O)C MCULE-7341190427 [1,1,0,0,0,0|0,0,1]=3
8  B27R3.605750903  CN1C(=O)C2=C(N=CN2CC(O)CNCC3=CC=CC=C3)N(C1=O)C MCULE-7132171865 [1,1,0,0,0,0|2,0,0]=4
9  B27R3.605750923  CN(CC1=CC=CC=C1)C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-8284129028 [0,1,0,0,1,0|1,0,1]=4
10  B27R3.605750915  CC(CC1=CC=CO1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-4307672103 [0,1,0,0,1,0|1,0,1]=4
11  B27R3.605750891  CC(NC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3 MCULE-5996699252 [0,1,0,0,1,0|0,0,1]=3
12  B27R3.605750891  CN(CC(O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3 MCULE-2983259164 [0,1,0,0,1,0|2,0,0]=4
13  B29R3.3560465393  CC(CCC1=CC=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-8146890520 [0,1,0,0,0,1|0,0,1]=3
14  B29R3.8878481660  CC(C(O)C1=CC=CC=C1)N(C)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-2303360045 [0,2,0,0,0,0|0,0,0]=2
15  B27R4.227087086  CN1C(=O)C2=C(N=C3N2CCN3CCC4=CC=CC=C4)N(C1=O)C MCULE-4517879901 [1,0,0,1,0,0|0,0,0]=2
16  B29R4.361316366  CC1CC2=C(N1C(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C=CC=C2 MCULE-9588963735 [0,1,0,1,0,0|0,0,1]=3
17  B25R3.152013197  CN(CC1=CC=CC=C1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C MCULE-3465967766 [0,0,0,0,2,0|1,0,0]=3